| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2004 | 21 | Yes |
1-S-Methane-4-N-(5-methyl-1,2-oxazol-3-yl)benzene-1,4-disulfonamido
N-(5-methyl-3-isoxazolyl)-4-[(methylsulfonyl)amino]benzenesulfonamide
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 0.77 | -6.91 | -19.75 | 2 | 8 | 0 | 118 | 331.375 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.77 | -6.34 | -45.44 | 1 | 8 | -1 | 120 | 330.367 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.77 | -6.36 | -50.67 | 1 | 8 | -1 | 120 | 330.367 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.77 | -5.78 | -95.95 | 0 | 8 | -2 | 122 | 329.359 | 5 | ↓ |
